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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-21540
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 48
  • Number of elements: 3
  • Element list: ['K', 'Sb', 'F']
  • Chemical System: F-K-Sb
  • Density: 3.700731716878609
  • Atomic Density: 0.056456358046540034
  • Unit Cell Volume: 850.2142479759499
  • Molar Volume: 10.666895578059824
  • Full Formula: K8 Sb8 F32
  • Reduced Formula: KSbF4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 59
  • Spacegroup Symbol: Pmmn1
  • Crystal System: orthorhombic
  • Pointgroup: mmm